(E)-1-(4-hydroxyphenyl)-3-[4-methoxy-3-[(3-nitropyrazol-1-yl)methyl]phenyl]prop-2-en-1-one

Systemtic Name: (E)-1-(4-hydroxyphenyl)-3-[4-methoxy-3-[(3-nitropyrazol-1-yl)methyl]phenyl]prop-2-en-1-one Openeye Name: (E)-1-(4-hydroxyphenyl)-3-[4-methoxy-3-[(3-nitropyrazol-1-yl)methyl]phenyl]prop-2-en-1-one CAS Name: (E)-1-(4-hydroxyphenyl)-3-[4-methoxy-3-[(3-nitro-1-pyrazolyl)methyl]phenyl]-2-propen-1-one IUPAC Name: (E)-1-(4-hydroxyphenyl)-3-[4-methoxy-3-[(3-nitropyrazol-1-yl)methyl]phenyl]prop-2-en-1-one Traditional Name: (E)-1-(4-hydroxyphenyl)-3-[4-methoxy-3-[(3-nitropyrazol-1-yl)methyl]phenyl]prop-2-en-1-one Formula: C20H17N3O5 MolecularWeight: 379.36608

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C=CC(=O)C2=CC=C(C=C2)O)CN3C=CC(=N3)[N+](=O)[O-]

Isomeric SMILES

COC1=C(C=C(C=C1)/C=C/C(=O)C2=CC=C(C=C2)O)CN3C=CC(=N3)[N+](=O)[O-]

InChI

InChI=1S/C20H17N3O5/c1-28-19-9-3-14(2-8-18(25)15-4-6-17(24)7-5-15)12-16(19)13-22-11-10-20(21-22)23(26)27/h2-12,24H,13H2,1H3/b8-2+